3H-1,3-benzothiazole-2-thione; 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-2-methyl-propanoic acid

Systemtic Name: 3H-1,3-benzothiazole-2-thione; 2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-2-methyl-propanoic acid Openeye Name: 3H-1,3-benzothiazole-2-thione; 2-(1,3-dioxoisoindolin-2-yl)oxy-2-methyl-propanoic acid CAS Name: 3H-1,3-benzothiazole-2-thione; 2-[(1,3-dioxo-2-isoindolyl)oxy]-2-methylpropanoic acid IUPAC Name: 3H-1,3-benzothiazole-2-thione; 2-(1,3-dioxoisoindol-2-yl)oxy-2-methylpropanoic acid Traditional Name: 3H-1,3-benzothiazole-2-thione; 2-methyl-2-phthalimidooxy-propionic acid Formula: C19H16N2O5S2 MolecularWeight: 416.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)ON1C(=O)C2=CC=CC=C2C1=O.C1=CC=C2C(=C1)NC(=S)S2

Isomeric SMILES

CC(C)(C(=O)O)ON1C(=O)C2=CC=CC=C2C1=O.C1=CC=C2C(=C1)NC(=S)S2

InChI

InChI=1S/C12H11NO5.C7H5NS2/c1-12(2,11(16)17)18-13-9(14)7-5-3-4-6-8(7)10(13)15;9-7-8-5-3-1-2-4-6(5)10-7/h3-6H,1-2H3,(H,16,17);1-4H,(H,8,9)